ChemSpider 2D Image | (1R)-1-(1,3-Benzodioxol-5-yl)-N-ethylethanamine | C11H15NO2

(1R)-1-(1,3-Benzodioxol-5-yl)-N-ethylethanamine

  • Molecular FormulaC11H15NO2
  • Average mass193.242 Da
  • Monoisotopic mass193.110275 Da
  • ChemSpider ID52085335

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(1R)-1-(1,3-Benzodioxol-5-yl)-N-ethylethanamin [German] [ACD/IUPAC Name]
(1R)-1-(1,3-Benzodioxol-5-yl)-N-ethylethanamine [ACD/IUPAC Name]
(1R)-1-(1,3-Benzodioxol-5-yl)-N-éthyléthanamine [French] [ACD/IUPAC Name]
1,3-Benzodioxole-5-methanamine, N-ethyl-α-methyl-, (αR)- [ACD/Index Name]
121734-66-5 [RN]
3,4-Methylenedioxyethylamphetamine

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

UNII:A188Q87602 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 268.0±29.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 50.6±3.0 kJ/mol
Flash Point: 107.5±13.7 °C
Index of Refraction: 1.535
Molar Refractivity: 54.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.26
ACD/LogD (pH 5.5): -1.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.78
Polar Surface Area: 30 Å2
Polarizability: 21.7±0.5 10-24cm3
Surface Tension: 41.0±3.0 dyne/cm
Molar Volume: 176.0±3.0 cm3

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